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Cortisol-[9,12,12-d3]

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General Information
Catalog: BLP-011497
CAS: 115699-92-8
Molecular Formula: C21H27D3O5
Molecular Weight: 365.48

Chemical Structure

Description	Cortisol-[9,12,12-d3] is the labelled analogue of Cortisol. Cortisol is a steroid hormone, in the glucocorticoid class of hormones. When used as a medication, it is known as hydrocortisone.
Synonyms	Cortisol-9,12,12-D3; (11β)-11,17,21-Trihydroxy-pregn-4-ene-3,20-dione-d3; Cortisol-d3; 11β,17,21-Trihydroxypregn-4-ene-3,20-dione-d3; 17α-Hydroxycorticosterone-d3; NSC 10483-d3; Hydrocortisone-d3; Acticort-d3; Cetacort-d3; Hydrasson-d3; Hydrocortisyl-d3
IUPAC Name	(8S,9S,10R,11S,13S,14S,17R)-9,12,12-trideuterio-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,11,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one
Related CAS	50-23-7 (unlabelled)
Canonical SMILES	CC12CCC(=O)C=C1CCC3C2C(CC4(C3CCC4(C(=O)CO)O)C)O
InChI	InChI=1S/C21H30O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h9,14-16,18,22,24,26H,3-8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1/i10D2,18D
InChI Key	JYGXADMDTFJGBT-GNVNMZRRSA-N
Melting Point	207-209°C
Purity	98%; 98% atom D
Solubility	Soluble in DMSO (Slightly), Methanol (Slightly, Heated)
Appearance	White to Off-white Solid
Storage	Store at -20°C under inert atmosphere